5-[4-[2-[2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]piperazin-1-yl]-2-methyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[2-[2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]piperazin-1-yl]-2-methyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[2-[2-(4-methoxyphenyl)azepan-1-yl]acetyl]piperazin-1-yl]-2-methyl-oxazole-4-carbonitrile CAS Name: 5-[4-[2-[2-(4-methoxyphenyl)-1-azepanyl]-1-oxoethyl]-1-piperazinyl]-2-methyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-[2-[2-(4-methoxyphenyl)azepan-1-yl]acetyl]piperazin-1-yl]-2-methyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[2-[2-(4-methoxyphenyl)azepan-1-yl]acetyl]piperazino]-2-methyl-oxazole-4-carbonitrile Formula: C24H31N5O3 MolecularWeight: 437.53464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(O1)N2CCN(CC2)C(=O)CN3CCCCCC3C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1=NC(=C(O1)N2CCN(CC2)C(=O)CN3CCCCCC3C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C24H31N5O3/c1-18-26-21(16-25)24(32-18)28-14-12-27(13-15-28)23(30)17-29-11-5-3-4-6-22(29)19-7-9-20(31-2)10-8-19/h7-10,22H,3-6,11-15,17H2,1-2H3